6-[(E)-2-[5-bromo-2-[(2-chlorophenyl)methoxy]phenyl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione

Formula:C19H13N3O5BrCl Mutagenic:high Tumorigenic:none Reproductive Effective:none 6-[(E)-2-[5-bromo-2-[(2-chlorophenyl)methoxy]phenyl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione is a drug-like molecule.

MolName	6-[(E)-2-[5-bromo-2-[(2-chlorophenyl)methoxy]phenyl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione
MolecularFormula	C19H13N3O5BrCl
Smiles	[O-][N+](C(C(N1)=O)=C(/C=C/c(cc(cc2)Br)c2OCc(cccc2)c2Cl)NC1=O)=O
InChI	InChI=1S/C19H13BrClN3O5/c20-13-6-8-16(29-10-12-3-1-2-4-14(12)21)11(9-13)5-7-15-17(24(27)28)18(25)23-19(26)22-15/h1-9H,10H2,(H2,22,23,25,26)
InChIK	LKWZFLQEKYHXCO-UHFFFAOYSA-N
TotalMolweight	478.685
Molweight	478.685
MonoisotopicMass	476.97271
CLogP	2.9753
CLogS	-6.317
H Acceptors	8
H Donors	2
TotalSurfaceArea	308.84
Relative PSA	0.28954
PolarSurfaceArea	113.25
Druglikeness	-4.7114
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.48276
Fragments	1
Non HAtoms	29
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Amides	2
AcidicOxygens	1
StereoCon

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